UCSF

ZINC27971234

Substance Information

In ZINC since Heavy atoms Benign functionality
February 22nd, 2009 25 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.71 3.7 -50.58 1 8 -1 108 376.443 6
Mid Mid (pH 6-8) 2.64 4.13 -23.38 2 8 0 109 377.451 5

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Analogs ( Draw Identity 99% 90% 80% 70% )